4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
Chemical Structure Depiction of
4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
Compound characteristics
Compound ID: | E645-2627 |
Compound Name: | 4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide |
Molecular Weight: | 479.96 |
Molecular Formula: | C26 H26 Cl N3 O4 |
Smiles: | CC(C)Oc1ccc(CNC(CCCN2C(c3cccnc3Oc3ccc(cc23)[Cl])=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.9831 |
logD: | 3.9831 |
logSw: | -4.4273 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.785 |
InChI Key: | OUTQWHFMKVVVCU-UHFFFAOYSA-N |